Computer Science and Mathematics Division All Staff Division

Computer Science and Mathematics Division All Staff Division Meeting December 10, 2002 Jeff Nichols, Director http: //www. csm. ornl. gov/IAO Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

2 CSMD (July 1, 2002 – December 10, 2002) · Really good people – good depth across CS&M and computational disciplines (fun to work with and nice too!) · Highly successful and motivated · Driven to be/define the best OASCR lab in the DOE system · Flies by the seat of Thomas’s pants · No changes made so far · Directorate needs infrastructure and support · JICS needs to be better defined and integrated Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

Outline · · · · 3 CSMD organizational structure Awards and recognition 2002 success stories Document clearance CSB, moves and JICS (Buddy Bland) Fiscal health of CSMD (Kyle Spence) Human resources issues (Nancy Wright) Staffing/Recruiting (Kyle Johnson) ES&H (Ross Toedte) Quality (Richard Counts) Information technology (Betsy Riley) New opportunities and expectations Q&A Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

4 CSMD Organizational Chart Computer Science and Mathematics Division J. A. Nichols, Director Complex Systems Group J. Barhen Computational Biology Group G. A. Geist (acting) Network and Cluster Computing Group G. A. Geist Computational Climate Group J. B. Drake Scientific Applications Support Group A. S. Bland Computational Materials Sciences Group T. C. Schulthess Systems and Operations Group A. S. Bland Computational Mathematics Group E. F. D’Azevedo (acting) Statistics and Data Sciences Group C. K. Bayne Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

5 Computer Science and Mathematics J. A. Nichols, Director C. Hamby, Secretary (Acting) Thom Dunning – Distinguished Scientist Jerry Bernholc – Visiting Distinguished Scientist Complex Systems J. Barhen L. C. Holbrook Y. Y. Braiman R. J. Carter C. D'Helon 1 W. R. Garrett 2 C. W. Glover W. P. Grice W. C. Grimmell D. L. Jung J. Kelly 5 Y-H. Kim S. M. Lenhart H. K. Liu 2 Y. Liu 1 L. E. Parker N. Peterfreund 2 V. Protopopescu N. S. V. Rao D. B. Reister N. Smith 5 D. R. Tufano J. C. Schryver Q. Wu 5 Computational Materials Science T. C. Schulthess T. S. Darland K. E. Anderson 5 G. A. Aramayo S. Barhen 5 G. P. Brown 1 R. G. Endres 1 O. J. Gonzalez 1 B. C. Hathorn 1 T. Kaplan P. R. Kent 1 H. K. Lee M. A. Majidi 1 V. Meunier 4 M. B. Nardelli 4 D. M. Nicholson D. W. Noid P. K. Nukala B. Radhakrishnan G. B. Sarma W. A. Shelton S. Shevlin 8 S. Simunovic A. V. Smirnov 1 B. G. Sumpter S-H. N. Tsai 1 J. C. Wells X-G. Zhang J. Zhong 1 Network and Cluster Computing G. A. Geist L. M. Wolfe D. E. Bernholdt M. J. Brim 2 M. L. Chen K. Chanchio V. Choppella 1 S. P. Dickson T. H. Dunigan W. R. Elwasif C. Engelmann 1 N. Fout 5 J. Gao 5 J. L. Hespen 5 G. Kora 5 J. A. Kohl C. Leangsuksun 7 B. Leuthke 3 J. L. Mugler 1 T. J. Naughton 1 P. E. Pfeiffer 7 J. A. Rome N. F. Samatova S. L. Scott J. C. Schwidder H. D. Shukla 1 T. Wilde W. R. Wing G. Yu 1 Systems and Operations Statistics and Data Science A. S. Bland A. D. Harris C. K. Bayne L. C. Holbrook R. A. Alexander M. W. Arnold T. O. Barron R. D. Burris F. M. Fowler 5 N. R. Hathaway T. K. Jones K. D. Matney D. E. Maxwell D. L. Million D. A. Steinert S. R. White V. L. White (11) SAIC staff R. W. Counts E. L. Frome B. M. Horwedel B. L. Jackson G. Ostrouchov B-H Park 3 L. Pouchard D. Schmoyer D. A. Wolf Climate Dynamics E. F. D’Azevedo T. S. Darland Finance K. R. Spence J. B. Drake L. M. Wolfe V. Alexiades V. K. Chakravarthy 1 Y-S Chan J. J. Dongarra G. Fann L. J. Gray B. C. Hathorn 1 R. J. Harrison A. K. Khamayseh R. B. Kiser 5 M. R. Leuze P. R. Luszczek 5 P. M. Mountiziaris 5 S. Pannala I. Tiourina 5 M. L. Branstetter 1 D. J. Erickson M. W. Ham J. L. Hernandez 1 G. Mahinthakumar 6 P. H. Worley Human Resources N. Y. Wright Information Specialist B. A. Riley Recruiting/ Staffing J. K. Johnson Computer Security T. K. Jones ESH/Facility 6010 & 6012 R. J. Toedte Facility 3546 D. E. Bernholdt 1 2 3 4 5 6 7 8 Post doc Subcontractor UT NCSU Student U. North Carolina Faculty JICS Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY Computational Mathematics Scientific Applications Support A. S. Bland A. D. Harris Fahey 3 M. R. R. A. Fahey C. P. Halloy 3 R. J. Toedte J. B. White, III K. L. Wong 3 Computational Biology Quality Assurance R. W. Counts G. A. Geist (acting) L. M. Wolfe P. K. Agarwal 1 T. Fridman 8 A. A. Gorin M. R. Leuze G. Ostrouchov L. C. Pouchard N. F. Samatova Y. Xu JAN CSMD All Staff 12/10/02

6 Computer Science and Mathematics J. A. Nichols, Director C. Hamby, Secretary (Acting) Thom Dunning – Distinguished Scientist Jerry Bernholc – Visiting Distinguished Scientist Complex Systems J. Barhen L. C. Holbrook Y. Y. Braiman R. J. Carter C. D'Helon 1 W. R. Garrett 2 C. W. Glover W. P. Grice W. C. Grimmell D. L. Jung J. Kelly 5 Y-H. Kim S. M. Lenhart H. K. Liu 2 Y. Liu 1 L. E. Parker N. Peterfreund 2 V. Protopopescu N. S. V. Rao D. B. Reister N. Smith 5 D. R. Tufano J. C. Schryver Q. Wu 5 Computational Materials Science T. C. Schulthess T. S. Darland K. E. Anderson 5 G. A. Aramayo S. Barhen 5 G. P. Brown 1 R. G. Endres 1 O. J. Gonzalez 1 B. C. Hathorn 1 T. Kaplan P. R. Kent 1 H. K. Lee M. A. Majidi 1 V. Meunier 4 M. B. Nardelli 4 D. M. Nicholson D. W. Noid P. K. Nukala B. Radhakrishnan G. B. Sarma W. A. Shelton S. Shevlin 8 S. Simunovic A. V. Smirnov 1 B. G. Sumpter S-H. N. Tsai 1 J. C. Wells X-G. Zhang J. Zhong 1 Network and Cluster Computing G. A. Geist L. M. Wolfe D. E. Bernholdt M. J. Brim 2 M. L. Chen K. Chanchio V. Choppella 1 S. P. Dickson T. H. Dunigan W. R. Elwasif C. Engelmann 1 N. Fout 5 J. Gao 5 J. L. Hespen 5 G. Kora 5 J. A. Kohl C. Leangsuksun 7 B. Leuthke 3 J. L. Mugler 1 T. J. Naughton 1 P. E. Pfeiffer 7 J. A. Rome N. F. Samatova S. L. Scott J. C. Schwidder H. D. Shukla 1 T. Wilde W. R. Wing G. Yu 1 Systems and Operations Statistics and Data Science A. S. Bland A. D. Harris C. K. Bayne L. C. Holbrook R. A. Alexander M. W. Arnold T. O. Barron R. D. Burris F. M. Fowler 5 N. R. Hathaway T. K. Jones K. D. Matney D. E. Maxwell D. L. Million D. A. Steinert S. R. White V. L. White (11) SAIC staff R. W. Counts E. L. Frome B. M. Horwedel B. L. Jackson G. Ostrouchov B-H Park 3 L. Pouchard D. Schmoyer D. A. Wolf Climate Dynamics E. F. D’Azevedo T. S. Darland Finance K. R. Spence J. B. Drake L. M. Wolfe V. Alexiades V. K. Chakravarthy 1 Y-S Chan J. J. Dongarra G. Fann L. J. Gray B. C. Hathorn 1 R. J. Harrison A. K. Khamayseh R. B. Kiser 5 M. R. Leuze P. R. Luszczek 5 P. M. Mountiziaris 5 S. Pannala I. Tiourina 5 M. L. Branstetter 1 D. J. Erickson M. W. Ham J. L. Hernandez 1 G. Mahinthakumar 6 P. H. Worley Human Resources N. Y. Wright Information Specialist B. A. Riley Recruiting/ Staffing J. K. Johnson Computer Security T. K. Jones ESH/Facility 6010 & 6012 R. J. Toedte Facility 3546 D. E. Bernholdt 1 2 3 4 5 6 7 8 Post doc Subcontractor UT NCSU Student U. North Carolina Faculty JICS Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY Computational Mathematics Scientific Applications Support A. S. Bland A. D. Harris Fahey 3 M. R. R. A. Fahey C. P. Halloy 3 R. J. Toedte J. B. White, III K. L. Wong 3 Computational Biology Quality Assurance R. W. Counts G. A. Geist (acting) L. M. Wolfe P. K. Agarwal 1 T. Fridman 8 A. A. Gorin M. R. Leuze G. Ostrouchov L. C. Pouchard N. F. Samatova Y. Xu JAN CSMD All Staff 12/10/02

Awards & Recognitions - Service · · · Bill Wing Ted Kaplan Don Noid Vasilios Alexiades Pat Worley Don Maxwell Lynne Parker Carole Holbrook Bill Shelton Bobby Sumpter Jack Wells 7 30 Years 25 Years 20 Years 15 Years 10 Years 5 Years Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

8 Awards & Recognitions cont. · Robert Harrison – Fernbach Memorial Award · Jacob Barhen – Recipient of NASA Space Act Award · Yoon-Ho Kim – Recipient of a Wigner Fellowship · Yoon-Ho Kim – Honorable Mention in the Association of Korean Physicists in · · · America Award Program for the Outstanding Young Researcher Award Al Geist – Corporate Fellow Kyle Johnson – UT Battelle Awards Night – Administrative Support Stephen Scott – Significant Event Award (OSCAR Project) David Bernholdt – Significant Event Award (Access Grid node @ ORNL) Buddy Bland – UT Battelle Awards Night – Laboratory Operations, Exempt Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

9 2002 Success Stories ORNL Breaks Ground on a New Computational Sciences Building ORNL has begun construction of a new 300, 000 -sq-ft laboratory and office building. Approximately 170, 000 sq ft will house the Center for Computational Sciences with a new 40, 000 -sq-ft computer center and office space for 350 staff members. The computer center will provide state-of-the-art facilities for modern high-performance computers. more Oak Ridge datapipe: Fast as the Wind The new computer link between DOE's Oak Ridge National Laboratory and Atlanta is 200, 000 times faster than the fastest dial-up connections typical of home computers and is expected to spur significant advances in science and economic development in the region and beyond. Ray Orbach, director of the DOE's Office of Science, symbolically completed the connection linking the laboratory's supercomputer to Southern Crossroads universities and other premier schools around the country. The link will connect DOE's ESnet computer network with Internet 2, the network of top-tier universities, at speeds up to 20 times faster than the previous ORNL connection. With the new link, a data file the size of the film Gone With the Wind could be transmitted in a mere six seconds. more ORNL to test new Cray X 1 for DOE On August 15, 2002, the Department of Energy announced that ORNL has been selected to test the effectiveness of a new Cray Inc. supercomputer architecture in solving important scientific problems in climate, fusion, biology, nanoscale materials and astrophysics. The Cray X 1 is designed to scale to deliver performance greater than currently available U. S. computers. more ORNL groundbreaking celebrates landmark partnership A groundbreaking ceremony held on August 22, 2002, at the Department of Energy's Oak Ridge National Laboratory marks a first-of-its-kind partnership among ORNL, the state of Tennessee and the University of Tennessee. Construction of the new facility to house the Joint Institute for Computational Sciences and the Oak Ridge Center for Advanced Studies occurs as part of a landmark project fusing the resources of DOE's largest multipurpose laboratory and the state's flagship university. more Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

2002 Success Stories – Supercomputing 2002 10 Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

2002 Success Stories – United Way 11 Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

Document Clearance 12 · Science products; publications are very important and are of high professional value · Increased emphasis on performance Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

Computational Sciences Building – Buddy Bland 13 · 40, 000 ft 2 computer center – largest in DOE/SC · Office and Lab space for our entire division · Expected completion – June 2003 First floor computer room is taking shape Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

14 CSB Infrastructure – Buddy Bland Pulling power cables to a 2 MW transformer Cooling water pipes in the computer room Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

15 CSB Infrastructure – Buddy Bland Cooling towers on the roof Three 1, 200 ton chillers in the central energy plant Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

Joint Institute for Computational Sciences – Buddy Bland · · 16 52, 000 ft 2 building Office, lab, and classroom space Conference center Scheduled completion January 2004 Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

17 Move Schedule – Buddy Bland · Moves into the CSB will probably occur in mid-July through August 2003. · Moves into ROB will be in Fall 2003. · Boxes will be provided for each office on a Monday. · Pack files, books, etc. into boxes and label with new room number by Wednesday. · Movers will take boxes to your new office on Thursday and Friday. · Technicians will move computers on Thursday and Friday. · Old offices must be left clean and free of excess equipment. If you have stuff you do not plan to move, start getting rid of it now. Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

CSMD Fiscal Health – Kyle Spence 18 $M FUNDS ON HAND by FY 2000 2001 2002 KJ - ASCR 11. 8 24. 6 29. 2 KC - BES 2. 7 2. 6 2. 8 KP - BER 2. 4 4. 2 1. 8 Other DOE 2. 0 2. 3 2. 4 DOD 2. 1 3. 2 2. 2 Other Fed. 1. 1 0. 8 0. 1 Non –Fed. 0. 5 0. 2 0. 4 Y-12 2. 0 1. 7 0. 3 Other WFO-OTH 1. 6 1. 9 1. 5 PD/LDRD/SEED 1. 6 1. 5 2. 0 27. 8 43. 0 42. 7 DOE WFO Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

19 CSMD Fiscal Health – Kyle Spence FTE (Full Time Equivalent) Comparison FY 02 FY 03 Wage Pool $65. 09/hr $68. 80/hr Organization Burden $26. 00/hr FTE – DOE Project $227 K $244 K FTE – WFO Project $235 K $252 K Assumptions -S&T C 7% Increase -FTE = 1805 Hours -ORNL On-Site Overhead -WFO = Outside DOE Family Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

CSMD Fiscal Health – Kyle Spence 20 CSMD Finance Reminders · Continuing Resolution · Network Charges: 3410 -0001 · Budget Process Begins in January · Input PALS each week by Friday Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

21 Human Resources for CSMD 3 POINTS OF CONTACT: · Nancy Wright: Human Resources Coordinator, Computing & Computational Sciences Directorate · Kevin Trent: Human Resources Manager, Human Resources and Diversity Programs Directorate · Kyle Johnson: Recruiting & Hiring Specialist, Human Resources and Diversity Programs Directorate Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

22 Human Resources Coordinator – Nancy Wright · Staffing Representative - Job Posting System (JPS) PADS Salary Planning Interpretation of HR Policy/Procedures · · Nonemployee Contact Organizational Management Manager for SAP Workforce Diversity Representative Awards Coordinator (Significant Event Awards, UT-Battelle Awards Night, Company Service Awards, etc. ) · Benefit Plans Coordinator · Security Clearance Coordinator · Other Administrative Issues for the Division Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

Current Issues for UT-Battelle Employees – Nancy Wright 23 · PADS & Salary Planning - November-January 25: Performance Review and Ratings Discussions with staff - December 30 -January 25: “White cards” with salary increases distributed to staff - January 31: 2003 Performance Plans entered into PADS and submitted for manager approval Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

CSMD Recruiting & Hiring Activity – Kyle Johnson · During FY 01 -02 · Special Projects: - 27 CSM staff - Earth Simulator Response - 20 JICS staff (Cray partnership) - Householder Fellowship - ORNL Wigner Fellowship · During FY 03 to date 24 5 CSM staff - 4 JICS staff - Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

Computing & Computational Sciences Directorate 25 FY 2003 Recruiting Projections Business Sensitive - Kyle Johnson Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

26 Safety Officer – Ross Toedte · ES&H point of contact · Interface between Environment, Health, Safety and Quality Division staff and CSMD · ESH(&Q) - Applies to ALL CSMD personnel (staff, visiting staff and - students, subcontractors) Dictated by federal and state laws, compliance with agency policies (OSHA, EPA, etc), and our subcontract with DOE Is not as involved for our division as most since we are mostly paper and bit pushers Applies to time at work AND away from work Is our first priority Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

27 Practically speaking… - Ross Toedte · Ensure buildings function properly (or nearly so) · Communicate changes in building status · Forward pertinent recall notices · Forward pertinent lessons learned · Work with lab points-of-contact to ensure safe working environments · Interface with crafts for necessary services · Request necessary surveys Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

ES&H focus topics for CSMD – Ross Toedte 28 Traffic - East campus construction zone - Intra-Lab travel - Bethel Valley Road • Ergonomics • Winter preparedness • Office tidiness Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

Recordable Injury/Illness Cases CY Through November 2001 and November 2002 – Ross Toedte 29 Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

30 Quality Assurance – Richard Counts · Performance Assessment · Description - Mandatory (as part of SBMS) annual assessment of the Division’s performance - Conducted by the Office of Independent Oversight (Jan Preston) - Review of documentation and personnel interviews · Purpose - Assess Division performance (Laboratory strategic objectives) - Identify and correct problems that hinder the Division from achieving its objectives Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

31 Quality Assurance – cont. – Richard Counts · Assessment Criteria 1. Approach (Self Assessment Plan) · Performance objectives identified · Measures of performance identified · Roles and responsibilities established 2. Deployment (Implementation) · Assessment process implemented as planned · Adequacy of assessment program to measure Division performance 3. Process Improvement (Effectiveness) · Actions identified, implemented, and tracked to closure · Identifies appropriate action for improvement or to prevent recurrence We will meet with Quality Division Personnel to learn more! Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

32 Information Technology Officer– Betsy Riley · Need monthly highlights! (Awards, milestones, pubs, presentations, mentions in the news, etc. ) · If you want to register a new URL (domain name) for the web, DON'T do it yourself--contact Tim Jones (qqa@ornl. gov) 241 -6647 so we can be sure it gets properly registered with the network. · Routine web changes can be sent to Webworks staff Fern Stooksbury or Laura Chavez-Becker - just click on the "webmaster" link for their contact info. · It's not too late to post handouts, powerpoints, etc. from SC 2002. Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

33 New Opportunities and Expectations · Opportunities - Ultrascale Simulation ($22 M) Computational Nanoscience ($6 M) GTL ($10 M) NSF, NIH by way of JICS … · Expectations - Compete and win; generous PDF to do so - Hire computational biology and math TGLs - Some reorganization to accommodate success, new hires (e. g. in Chemistry), and JICS - Add infrastructure (weekly TGL meetings, monthly division support meetings, quarterly all staff meetings, etc) - Open office; open communication Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02

Q & A 34 Computer Science and Mathematics Division OAK RIDGE NATIONAL LABORATORY U. S. DEPARTMENT OF ENERGY JAN CSMD All Staff 12/10/02